2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide

C10H18N4O2 — CID 133383063

IUPAC2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNc1nc(C(C)C)no1
InChIInChI=1S/C10H18N4O2/c1-4-5-11-8(15)6-12-10-13-9(7(2)3)14-16-10/h7H,4-6H2,1-3H3,(H,11,15)(H,12,13,14)
InChIKeyPJFPTUYLEHIFDX-UHFFFAOYSA-N
MW226.28 g/mol
LogP1.13
Rot. Bonds6

About 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide

2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide (PubChem CID 133383063) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide
PubChem CID133383063
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNc1nc(C(C)C)no1
InChIInChI=1S/C10H18N4O2/c1-4-5-11-8(15)6-12-10-13-9(7(2)3)14-16-10/h7H,4-6H2,1-3H3,(H,11,15)(H,12,13,14)
InChIKeyPJFPTUYLEHIFDX-UHFFFAOYSA-N
XLogP1.13
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,5-dihydropyrrol-1-yl)-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]ethanone
CID 166271466
2-[methyl-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]amino]-N-propylacetamide
CID 24648763
N'-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethane-1,2-diamine
CID 83827200
1-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]propan-2-ol
CID 130621708
N-propyl-2-[[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]acetamide
CID 106969227
N-[3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propyl]pentanamide
CID 60590938
2-[1-[[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]methyl]cyclopropyl]ethanol
CID 133496790
2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]-N-propylacetamide
CID 79250505
(2S)-3-methyl-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]butanoic acid
CID 122049666
2-[(4-amino-1,3-benzoxazol-2-yl)amino]-N-propylacetamide
CID 79891169
5-(methylamino)-N-[2-oxo-2-(propylamino)ethyl]-2-propan-2-ylpyrimidine-4-carboxamide
CID 62168386
2-[(5-amino-1,3-benzoxazol-2-yl)amino]-N-propylacetamide
CID 79885020

Frequently Asked Questions

What is the IUPAC name of 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide?
The IUPAC name of 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide (CID 133383063) is 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide?
The canonical SMILES for 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide is CCCNC(=O)CNc1nc(C(C)C)no1.
What is the InChIKey of 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide?
The InChIKey is PJFPTUYLEHIFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-4-5-11-8(15)6-12-10-13-9(7(2)3)14-16-10/h7H,4-6H2,1-3H3,(H,11,15)(H,12,13,14).
What are the key properties of 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide?
2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide has a molecular weight of 226.28 g/mol, XLogP of 1.13, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]-N-propylacetamide is sourced from PubChem (CID 133383063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).